%chk=000179262.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179262

0 1
Br 1.773359 2.295147 1.083300
Br 0.249191 -2.813508 -0.752847
Br 5.822378 -1.303962 -0.105258
Cl -5.716970 2.901633 -0.886811
S -2.919579 1.942647 -1.463283
F -2.576885 -2.155901 0.579021
F -2.551418 -0.877892 2.270994
F -4.388282 -1.644515 1.542293
O -0.596132 -0.131170 -2.051347
O 5.092715 1.902720 -0.081266
O 4.934642 1.213931 1.970707
N -0.116314 0.039688 0.197713
N -4.520382 0.800147 0.228471
N 4.633858 1.205759 0.796633
C 1.254311 -0.335777 0.093876
C -2.336994 0.569133 -0.599877
C 2.238558 0.590987 0.472502
C -3.316706 0.082153 0.235126
C -0.967440 0.106289 -0.925115
C 3.575391 0.229535 0.391033
C 1.644199 -1.615188 -0.348760
C 3.959557 -1.032358 -0.068910
C 2.994692 -1.969329 -0.445390
C -3.227950 -1.122470 1.135811
C -4.467262 1.818208 -0.614037
H -0.428931 0.368573 1.117600
H 3.288794 -2.962579 -0.803080


%chk=000179262-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179262

0 1
Br 1.659693 1.957496 1.670994
Br 0.401252 -2.793400 -1.480636
Br 5.885930 -1.436186 -0.436972
Cl -6.237604 2.067656 -1.556506
S -3.223163 1.448187 -1.997469
F -2.536042 -1.853411 1.303594
F -1.991831 0.070187 2.382976
F -4.127851 -0.692773 2.417110
O -0.502478 0.319156 -2.130214
O 5.113001 1.900879 0.524147
O 4.869228 0.657389 2.430009
N -0.151532 -0.080900 0.149732
N -4.612058 0.698048 0.158225
N 4.593893 0.947629 1.209384
C 1.226549 -0.405514 0.012834
C -2.389327 0.537313 -0.676595
C 2.211968 0.400363 0.647447
C -3.305605 0.241044 0.339425
C -0.947943 0.245025 -0.947421
C 3.581781 0.092515 0.526038
C 1.671680 -1.541644 -0.719678
C 4.002531 -1.011368 -0.245178
C 3.043107 -1.831200 -0.868654
C -3.028048 -0.556186 1.587117
C -4.726294 1.339431 -0.982968
H -0.510221 0.085310 1.097047
H 3.359784 -2.703145 -1.444689


